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1-Benzyl-4-hydroxy-4-methyl-5-oxo-pyrrolidine-3-carbonitrile
SpectraBase Compound ID 4FUhhUjyCxV
InChI InChI=1S/C13H14N2O2/c1-13(17)11(7-14)9-15(12(13)16)8-10-5-3-2-4-6-10/h2-6,11,17H,8-9H2,1H3
InChIKey LOXQAQFMBRSYLV-UHFFFAOYSA-N
Mol Weight 230.27 g/mol
Molecular Formula C13H14N2O2
Exact Mass 230.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G36O11RBsAi
Name 1-Benzyl-4-hydroxy-4-methyl-5-oxo-pyrrolidine-3-carbonitrile
Alternate Name(s) 1-Benzyl-4-hydroxy-5-keto-4-methyl-pyrrolidine-3-carbonitrile 4-Hydroxy-4-methyl-5-oxo-1-(phenylmethyl)-3-pyrrolidinecarbonitrile 4-Methyl-4-oxidanyl-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carbonitrile
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Formula C13H14N2O2
InChI InChI=1S/C13H14N2O2/c1-13(17)11(7-14)9-15(12(13)16)8-10-5-3-2-4-6-10/h2-6,11,17H,8-9H2,1H3
InChIKey LOXQAQFMBRSYLV-UHFFFAOYSA-N
Molecular Weight 230.267 g/mol
SMILES OC1(C(N(CC1C#N)Cc1ccccc1)=O)C
SPLASH splash10-0006-9130000000-2304c7a54dea6c40a63e
Source of Spectrum F-51-9640-7
Wiley ID 793183